O2-(4-bromophenyl) O1-(4-methylpentyl) benzene-1,2-dicarboxylate

Systemtic Name: O2-(4-bromophenyl) O1-(4-methylpentyl) benzene-1,2-dicarboxylate Openeye Name: O2-(4-bromophenyl) O1-isohexyl benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid O2-(4-bromophenyl) ester O1-(4-methylpentyl) ester IUPAC Name: 2-O-(4-bromophenyl) 1-O-(4-methylpentyl) benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid O2-(4-bromophenyl) ester O1-isohexyl ester Formula: C20H21BrO4 MolecularWeight: 405.28234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC(=O)C1=CC=CC=C1C(=O)OC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)CCCOC(=O)C1=CC=CC=C1C(=O)OC2=CC=C(C=C2)Br

InChI

InChI=1S/C20H21BrO4/c1-14(2)6-5-13-24-19(22)17-7-3-4-8-18(17)20(23)25-16-11-9-15(21)10-12-16/h3-4,7-12,14H,5-6,13H2,1-2H3